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Title
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Bosonised DFT potential estimated from QMC calculations of the ground-state density for the inhomogeneous electron liquid in Be
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Author
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Abstract
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| To avoid the solution of numerous Kohn-Sham one-body potential equations for wave functions in density functional theory, various groups independently proposed the use of Pauli potential to bosonise the customary one-body potential theory. Here, we utilise our recent quantum Monte Carlo calculations of the ground-state electron density of the Be atom to estimate the bosonised one-body potential V-B(r) and hence extract the Pauli potential for this atom. |
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Language
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English
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Source (journal)
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Physics and chemistry of liquids. - London
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Publication
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London
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2015
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ISSN
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0031-9104
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DOI
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10.1080/00319104.2015.1020806
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Volume/pages
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53
:6
(2015)
, p. 679-684
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ISI
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000357487800001
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Full text (Publisher's DOI)
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Full text (publisher's version - intranet only)
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